General Information of the Compound
| Compound ID |
CP0413587
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-[[7-(2-fluoro-6-methoxyphenyl)-1,3-benzoxazol-2-yl]amino]benzenesulfonamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H16FN3O4S
|
||||||||||||||||||
| Molecular Weight |
413.43
|
||||||||||||||||||
| Canonical SMILES |
COc1cccc(F)c1-c1cccc2nc(Nc3cccc(c3)S(N)(=O)=O)oc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H16FN3O4S/c1-27-17-10-4-8-15(21)18(17)14-7-3-9-16-19(14)28-20(24-16)23-12-5-2-6-13(11-12)29(22,25)26/h2-11H,1H3,(H,23,24)(H2,22,25,26)
Show/Hide
|
||||||||||||||||||
| InChIKey |
OTMPGQSHVZZPJK-UHFFFAOYSA-N
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound